3389-1368 Screening compound: 11-(4-bromophenyl)-5,10-diazatetraphen-12-yl propanoate

3389-1368 Screening compound: 11-(4-bromophenyl)-5,10-diazatetraphen-12-yl propanoate
3389-1368 Screening compound: 11-(4-bromophenyl)-5,10-diazatetraphen-12-yl propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3389-1368
11-(4-bromophenyl)-5,10-diazatetraphen-12-yl propanoate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3389-1368

Molecular Formula

C25H17BrN2O2 (C25 H17 BrN2 O2)

Compound Name

11-(4-bromophenyl)-5,10-diazatetraphen-12-yl propanoate

IUPAC name

11-(4-bromophenyl)-510-diazatetraphen-12-yl propanoate

SMILES

CCC(Oc1c(-c(cc2)ccc2Br)c2nc3ccccc3nc2c2ccccc12)=O

InChI

InChI=1S/C25H17BrN2O2/c1-2-21(29)30-25-18-8-4-3-7-17(18)23-24(22(25)15-11-13-16(26)14-12-15)28-20-10-6-5-9-19(20)27-23/h3-14H,2H2,1H3

InChI Key

JJORMXAVIKLJCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01171588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.33

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.008

Distribution Coefficient, logD

7.008

Water Solubility, LogSw

-6.09

Polar Surface Area

38.098

Acid Dissociation Constant (pKa)

21.77

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

3389-1368 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 3389-1368 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3389-1368?
Check Price and Availability of 3389-1368, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3389-1368 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3389-1368
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3389-1368
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3389-1368 available by request